Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 17/20 | 0.67 |
| ▸ | ITGAV | P06756 | 17/20 | 0.67 |
| ▸ | ITGA2B | P08514 | 5/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.44 |
| ▸ | ITGB6 | P18564 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7104742 | 0.90 | ITGB3 (0.68) | ITGB3ITGAVITGA2BKMT2AITGB5 | |
| SCHEMBL7106602 | 0.90 | ITGB3 (0.67) | ITGB3ITGAVITGA2BHTTSMN1; SMN2 | |
| SCHEMBL7098907 | 0.90 | ITGB3 (0.67) | ITGB3ITGAVITGA2BKMT2AHTT | |
| SCHEMBL7103918 | 0.90 | ITGB3 (0.67) | ITGB3ITGAVITGA2B | |
| SCHEMBL7104776 | 0.88 | ITGB3 (0.68) | ITGB3ITGAVITGA2B | |
| SCHEMBL7099691 | 0.86 | ITGB3 (0.67) | ITGB3ITGAVITGA2BKMT2AITGB5 | |
| SCHEMBL7099298 | 0.83 | ITGB3 (0.66) | ITGB3ITGAVITGA2BHTTSMN1; SMN2 | |
| SCHEMBL13703191 | 0.82 | ITGB3 (0.57) | ITGB3ITGAVITGA2BHTTSMN1; SMN2 | |
| SCHEMBL7105696 | 0.82 | ITGB3 (0.51) | ITGB3ITGAVITGA2BKMT2ASMN1; SMN2 | |
| SCHEMBL7099697 | 0.80 | ITGB3 (0.68) | ITGB3ITGAVITGA2BHTTSMN1; SMN2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6649613-B1 | Integrin inhibitors | MERCK PATENT GMBH (DE) | 2003-11-18 | — | — | US | disclosed |
| EP-1194401-B1 | DIACYLHYDRAZINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2003-09-10 | — | — | EP | disclosed |
| EP-1194401-A1 | DIACYLHYDRAZINE DERIVATIVES | MERCK PATENT GmbH (DE) | 2002-04-10 | — | — | EP | disclosed |
| WO-2001005753-A1 | DIACYLHYDRAZINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2001-01-25 | — | — | WO | disclosed |